Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PDE4B | Q07343 | 1/20 | 0.60 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.54 |
| ▸ | NPC1 | O15118 | 2/20 | 0.54 |
| ▸ | RAB9A | P51151 | 2/20 | 0.54 |
| ▸ | BCL9 | O00512 | 9/20 | 0.52 |
| ▸ | CTNNB1 | P35222 | 9/20 | 0.52 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.52 |
| ▸ | USP30 | Q70CQ3 | 1/20 | 0.52 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.51 |
| ▸ | POLB | P06746 | 1/20 | 0.51 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.49 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.49 |
| ▸ | GAA | P10253 | 1/20 | 0.49 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.49 |
| ▸ | MAPT | P10636 | 1/20 | 0.49 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.49 |
| ▸ | HTT | P42858 | 1/20 | 0.49 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.49 |
| ▸ | JAK2 | O60674 | 1/20 | 0.47 |
| ▸ | JAK1 | P23458 | 1/20 | 0.47 |
Click a target to see other patent compounds predicted against it — the reverse direction, in place.
Similar compounds — the chemically nearest patent molecules
Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.
| Compound | similarity | top predicted | shared targets | |
|---|---|---|---|---|
| SCHEMBL21815338 | 1.00 | PDE4B (0.60) | PDE4BSMN1; SMN2NPC1RAB9ABCL9 | |
| SCHEMBL31198753 | 0.93 | SMN1; SMN2 (0.60) | PDE4BSMN1; SMN2NPC1RAB9ABCL9 | |
| SCHEMBL31198939 | 0.88 | SMN1; SMN2 (0.54) | PDE4BSMN1; SMN2NPC1RAB9ABCL9 | |
| SCHEMBL31198971 | 0.87 | PDE4B (0.60) | PDE4BSMN1; SMN2NPC1RAB9ACYP2C19 | |
| SCHEMBL19405064 | 0.86 | PDE4B (0.60) | PDE4BSMN1; SMN2NPC1RAB9ABCL9 | |
| SCHEMBL15168301 | 0.84 | SMN1; SMN2 (0.51) | PDE4BSMN1; SMN2NPC1RAB9ACYP2C19 | |
| SCHEMBL15187996 | 0.84 | SMN1; SMN2 (0.51) | PDE4BSMN1; SMN2NPC1RAB9ACYP2C19 | |
| SCHEMBL4389070 | 0.84 | SMN1; SMN2 (0.51) | PDE4BSMN1; SMN2NPC1RAB9ACYP2C19 | |
| SCHEMBL21815390 | 0.82 | SIGMAR1 (0.55) | PDE4BSMN1; SMN2NPC1RAB9ABCL9 | |
| SCHEMBL29087342 | 0.82 | SMN1; SMN2 (0.59) | PDE4BSMN1; SMN2NPC1RAB9ABCL9 |
Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.
Patent provenance — the patents this molecule appears in, and who filed them
Claimed or disclosed in 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-112752755-A | Heterocyclyl compounds for the treatment of autoimmune diseases | 豪夫迈·罗氏有限公司 | 2021-05-04 | — | — | CN | disclosed |